1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine

C17H18Cl2N2 — CID 764854

IUPAC1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine
SMILESClc1ccc(CN2CCN(c3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C17H18Cl2N2/c18-15-3-1-14(2-4-15)13-20-9-11-21(12-10-20)17-7-5-16(19)6-8-17/h1-8H,9-13H2
InChIKeyRNZXTRZEUUYLNP-UHFFFAOYSA-N
MW321.25 g/mol
LogP4.32
Rot. Bonds3

About 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine

1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine (PubChem CID 764854) has the molecular formula C17H18Cl2N2 and a molecular weight of 321.25 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine
PubChem CID764854
Molecular FormulaC17H18Cl2N2
Molecular Weight321.25 g/mol
Exact Mass320.08
IUPAC Name1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine
SMILESClc1ccc(CN2CCN(c3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C17H18Cl2N2/c18-15-3-1-14(2-4-15)13-20-9-11-21(12-10-20)17-7-5-16(19)6-8-17/h1-8H,9-13H2
InChIKeyRNZXTRZEUUYLNP-UHFFFAOYSA-N
XLogP4.32
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.25
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Piperazine, 1-phenethyl-4-phenyl-
CID 120540
1-Benzyl-4-phenylpiperazine
CID 511484
1-Benzyl-4-(3-chlorophenyl)piperazine
CID 413525
1-Phenyl-4-(3-phenylpropyl)piperazine
CID 743379
1-(4-Chlorophenyl)-4-hexylpiperazine
CID 3738741
2-[4-(5-Chloro-2-methylphenyl)piperazin-1-yl]ethanamine
CID 3237236
1-(2-Chlorophenyl)-4-(2-phenylethyl)piperazine
CID 409926
1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine
CID 2845469
1-(2-Chlorophenyl)-4-(3-phenylpropyl)piperazine
CID 2845629
1-(4-Chloro-phenyl)-4-(3-phenyl-propyl)-piperazine
CID 3299322
1-Phenyl-4-(4-phenyl-butyl)-piperazine
CID 15723883
N-(3-chlorophenyl)-1-(2-phenylethyl)-4-piperidinamine
CID 52934004

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine?
The IUPAC name of 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine (CID 764854) is 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine.
What is the SMILES notation for 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine?
The canonical SMILES for 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine is Clc1ccc(CN2CCN(c3ccc(Cl)cc3)CC2)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine?
The InChIKey is RNZXTRZEUUYLNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2/c18-15-3-1-14(2-4-15)13-20-9-11-21(12-10-20)17-7-5-16(19)6-8-17/h1-8H,9-13H2.
What are the key properties of 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine?
1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine has a molecular weight of 321.25 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-4-[(4-chlorophenyl)methyl]piperazine is sourced from PubChem (CID 764854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).